2-(4-chlorophenoxy)-N-[2-(dimethylamino)ethyl]-2-methylpropanamide

C14H21ClN2O2 — CID 2184467

IUPAC2-(4-chlorophenoxy)-N-[2-(dimethylamino)ethyl]-2-methylpropanamide
SMILESCN(C)CCNC(=O)C(C)(C)Oc1ccc(Cl)cc1
InChIInChI=1S/C14H21ClN2O2/c1-14(2,13(18)16-9-10-17(3)4)19-12-7-5-11(15)6-8-12/h5-8H,9-10H2,1-4H3,(H,16,18)
InChIKeyCFVANZOOUNMRET-UHFFFAOYSA-N
MW284.79 g/mol
LogP2.18
Rot. Bonds6

About 2-(4-chlorophenoxy)-N-[2-(dimethylamino)ethyl]-2-methylpropanamide

2-(4-chlorophenoxy)-N-[2-(dimethylamino)ethyl]-2-methylpropanamide (PubChem CID 2184467) has the molecular formula C14H21ClN2O2 and a molecular weight of 284.79 g/mol. Its IUPAC name is 2-(4-chlorophenoxy)-N-[2-(dimethylamino)ethyl]-2-methylpropanamide.

Molecular Properties

Compound Name2-(4-chlorophenoxy)-N-[2-(dimethylamino)ethyl]-2-methylpropanamide
PubChem CID2184467
Molecular FormulaC14H21ClN2O2
Molecular Weight284.79 g/mol
Exact Mass284.13
IUPAC Name2-(4-chlorophenoxy)-N-[2-(dimethylamino)ethyl]-2-methylpropanamide
SMILESCN(C)CCNC(=O)C(C)(C)Oc1ccc(Cl)cc1
InChIInChI=1S/C14H21ClN2O2/c1-14(2,13(18)16-9-10-17(3)4)19-12-7-5-11(15)6-8-12/h5-8H,9-10H2,1-4H3,(H,16,18)
InChIKeyCFVANZOOUNMRET-UHFFFAOYSA-N
XLogP2.18
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.79
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenoxy)-N-[2-(dimethylamino)ethyl]-2-methylpropanamide?
The IUPAC name of 2-(4-chlorophenoxy)-N-[2-(dimethylamino)ethyl]-2-methylpropanamide (CID 2184467) is 2-(4-chlorophenoxy)-N-[2-(dimethylamino)ethyl]-2-methylpropanamide.
What is the SMILES notation for 2-(4-chlorophenoxy)-N-[2-(dimethylamino)ethyl]-2-methylpropanamide?
The canonical SMILES for 2-(4-chlorophenoxy)-N-[2-(dimethylamino)ethyl]-2-methylpropanamide is CN(C)CCNC(=O)C(C)(C)Oc1ccc(Cl)cc1.
What is the InChIKey of 2-(4-chlorophenoxy)-N-[2-(dimethylamino)ethyl]-2-methylpropanamide?
The InChIKey is CFVANZOOUNMRET-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21ClN2O2/c1-14(2,13(18)16-9-10-17(3)4)19-12-7-5-11(15)6-8-12/h5-8H,9-10H2,1-4H3,(H,16,18).
What are the key properties of 2-(4-chlorophenoxy)-N-[2-(dimethylamino)ethyl]-2-methylpropanamide?
2-(4-chlorophenoxy)-N-[2-(dimethylamino)ethyl]-2-methylpropanamide has a molecular weight of 284.79 g/mol, XLogP of 2.18, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenoxy)-N-[2-(dimethylamino)ethyl]-2-methylpropanamide is sourced from PubChem (CID 2184467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).